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MolNFT v1 · #148555 · protein

Antibody derived (abd-5) small molecule binding to KRAS.

6FA2: “Antibody derived (abd-5) small molecule binding to KRAS.”. X-ray diffraction, 3 ligands (GNP, D2W, MG). MolNFT v1 #148555 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6FA2
Type
protein
Length
980 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P01116
Ligands
GNP, D2W, MG

Structure

x-ray diffraction · 6 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein167—P01116
B—protein168—P01116
C—protein165—P01116
D—protein158—P01116
E—protein164—P01116
F—protein158—P01116

Ligands and binding sites

  • GNP · Phosphoaminophosphonic acid-guanylate ester · ligand · 6 copies · chains A, B, C, D, E, F
  • D2W · 4-[2-(dimethylamino)ethoxy]-~{N}-[[(3~{R})-5-(6-methoxypyridin-2-yl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]benzamide · ligand · 6 copies · chains A, B, C, D, E, F
  • MG · Magnesium ion · metal · 6 copies · chains A, B, C, D, E, F

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6FA2 · Antibody derived (Abd-5) small molecule binding to KRAS. · the same entry in another collection · chain A against A, TM-score 1.00

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